Accuracy

triethyl 1,1,1-ethanetricarboxylate   1446 Triethyl 1,1,1-ethanetricarboxylate

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    #  Species Formula
  1436 THR-THRC8H16N2O5
  1437 Li(+)(H2O)5.OHH11LiO6
  1438 Li(+)(H2O)5.OH (Geo)H11LiO6
  1439 Li(+)(H2O)6H12LiO6
  1440 Li(+)(H2O)6 (Geo)H12LiO6
  1441 B3O3(OH)3H3B3O6
  1442 Tri-acetyl borate (Geo)H9BC6O6
  1443 Tri-acetyl borateH9BC6O6
  1444 Trimethyl methanetricarboxylateC7H10O6
  1445 Triethyl methanetricarboxylateC10H16O6
  1446 Triethyl 1,1,1-ethanetricarboxylate C11H18O6
  1447 Li(I)O6(+) (COLGEP) (Geo)H30LiC12O6
  1448 Li(I)O6(+) (COLGEP)H30LiC12O6
  1449 Li(I)O6(+) (LOLNOP01) (Geo)H30LiC12O6
  1450 Li(I)O6(+) (LOLNOP01)H30LiC12O6
  1451 Li(I)O4 (FECWIT) (Geo)H10LiC6NO6
  1452 Li(I)O4 (FECWIT)H10LiC6NO6
  1453 Trinitromethane (Geo)HCN3O6
  1454 TrinitromethaneHCN3O6
  1455 1,1,1-TrinitroethaneC2H3N3O6
  1456 2,4,6-TrinitrotolueneC7H5N3O6


ΔHf: -286.2 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Triethyl 1,1,1-ethanetricarboxylate
 H=-286.19 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52595966 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.52073807 +1  110.2940795 +1    0.0000000 +0     2     1     0
  O     1.35053956 +1  108.8244613 +1   55.3603073 +1     3     2     1
  C     1.43946277 +1  115.9016116 +1  177.2362676 +1     4     3     2
  O     1.19987539 +1  127.3306007 +1 -124.3174543 +1     3     2     1
  C     1.52693556 +1  108.8318984 +1  120.4365799 +1     2     1     3
  O     1.19905174 +1  126.1895049 +1   27.4578263 +1     7     2     1
  O     1.34762518 +1  108.7764196 +1 -152.1282121 +1     7     2     1
  C     1.52247837 +1  110.1581813 +1 -120.5506100 +1     2     1     3
  O     1.20096142 +1  126.4879623 +1 -124.4446859 +1    10     2     1
  O     1.34643975 +1  109.2348430 +1   54.1877644 +1    10     2     1
  C     1.43216421 +1  117.3954517 +1  179.1553411 +1     9     7     2
  C     1.51823639 +1  109.6508146 +1  -77.7431578 +1    13     9     7
  C     1.44158150 +1  115.7367017 +1  176.6264323 +1    12    10     2
  C     1.51840602 +1  103.5979732 +1 -177.1364155 +1    15    12    10
  C     1.51889314 +1  103.6755533 +1 -179.5552840 +1     5     4     3
  H     1.09951565 +1  111.7317472 +1   62.7421239 +1     1     2     3
  H     1.10184371 +1  111.2930713 +1 -176.7964305 +1     1     2     3
  H     1.10086719 +1  111.5124037 +1  -57.6863326 +1     1     2     3
  H     1.10456570 +1  108.3502617 +1  -59.1453444 +1     5     4     3
  H     1.10406954 +1  108.4846952 +1   59.7819585 +1     5     4     3
  H     1.10519390 +1  109.5202674 +1   46.5169020 +1    13     9     7
  H     1.10712282 +1  101.0021372 +1  162.7233008 +1    13     9     7
  H     1.09716912 +1  111.4313894 +1  -50.8344567 +1    14    13     9
  H     1.09985190 +1  111.1861284 +1   68.6432411 +1    14    13     9
  H     1.09564504 +1  111.4464651 +1 -171.4024459 +1    14    13     9
  H     1.10500451 +1  108.4479581 +1  -56.8435434 +1    15    12    10
  H     1.10372189 +1  108.3031643 +1   62.2118611 +1    15    12    10
  H     1.09749461 +1  111.5832395 +1  -60.8607482 +1    16    15    12
  H     1.09979478 +1  111.1043680 +1   58.3303465 +1    16    15    12
  H     1.09582099 +1  111.1612433 +1  178.4469472 +1    16    15    12
  H     1.09816258 +1  111.4345729 +1  -60.8113797 +1    17     5     4
  H     1.09848598 +1  111.3007166 +1   58.3647275 +1    17     5     4
  H     1.09599690 +1  111.1362380 +1  178.7036737 +1    17     5     4